Geometry & MOs

Info

ID:

299286

PubChem CID:

117682491

Reduced:

NOH30C34 (2)

Stoich.:

ABC30D34 (2)

Weight, g/mol:

1036.424008

ΔHf, kcal/mol:

93.14

Dipole, Da:

2.14

IP(EA), eV:

 -7.74(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis[6-(2-methylbutan-2-yl)dibenzofuran-4-yl]pyrene-1,6-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)C)N(C2=C3C=CC4=C5C3=C(C=CC5=C(C=C4)N(C6=CC=CC7=C6OC8=C7C=CC=C8C9CCCC9)C1=CC(=C(C(=C1)C)C)C)C=C2)C1=CC=CC2=C1OC1=C2C=CC=C1C1CCCC1

DOS

IR

Vibrations